PUBCHEM-ZINC05849537 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 61 0 0 1 0 0 0 0 0999 V2000 -0.3340 1.6690 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 0.1740 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 0.0430 1.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6980 -0.1560 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 1.3540 1.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 2.1510 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 1.7220 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 1.1700 3.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 2.8370 1.6230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0670 3.7210 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 2.2820 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 3.3360 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 2.6980 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 3.7010 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -1.0590 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -0.9060 0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -2.2390 0.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.3860 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -3.2770 -0.3360 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2020 -3.1820 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -4.6790 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -5.0130 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -6.4770 1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -6.8550 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -3.0640 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -1.8540 -2.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.8880 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 2.1370 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.2390 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.3420 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 1.9130 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 3.2220 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 1.5230 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 1.7510 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 4.1450 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 3.7770 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 1.8770 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 2.2540 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 4.5340 -2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 4.0860 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.7780 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -5.4310 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -4.8340 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -4.3610 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -6.6520 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -7.1230 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -6.7120 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -6.3090 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 3.0230 -3.2860 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2420 3.6510 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 2.6940 -3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1510 2.1940 -3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 3.2750 2.8170 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8100 2.4270 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 3.6930 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 3.9370 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -8.2990 3.4390 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8030 -8.6010 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -8.8740 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -8.5080 3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -4.1150 -2.5970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 53 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 49 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 61 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 57 60 1 0 0 0 0 M CHG 1 49 1 M CHG 1 53 1 M CHG 1 57 1 M CHG 1 61 -1 M END